Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 9/20 | 0.59 |
| ▸ | CA12 | O43570 | 8/20 | 0.59 |
| ▸ | CA1 | P00915 | 8/20 | 0.59 |
| ▸ | CA9 | Q16790 | 8/20 | 0.59 |
| ▸ | CA7 | P43166 | 4/20 | 0.59 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | SERPINE1 | P05121 | 4/20 | 0.52 |
| ▸ | CA4 | P22748 | 4/20 | 0.51 |
| ▸ | CA5A | P35218 | 1/20 | 0.51 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.49 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | HRH1 | P35367 | 2/20 | 0.47 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7074820 | 0.85 | CA2 (0.68) | CA2CA12CA1CA9CA7 | |
| SCHEMBL30428139 | 0.79 | CHRNA7 (0.65) | CYP3A4CYP2D6CYP2C9SERPINE1CYP2C19 | |
| SCHEMBL23291337 | 0.79 | CHRNA7 (0.65) | CYP3A4CYP2D6CYP2C9SERPINE1CYP2C19 | |
| SCHEMBL4853590 | 0.78 | CA2 (0.50) | CA2CA12CA1CA9CA7 | |
| SCHEMBL7771595 | 0.78 | CA2 (0.50) | CA2CA12CA1CA9CA7 | |
| SCHEMBL23649422 | 0.77 | SMN1; SMN2 (0.66) | CYP3A4CYP2D6CYP2C9TSHRCYP1A2 | |
| SCHEMBL9773543 | 0.77 | CA2 (0.74) | CA2CA12CA1CA9CA7 | |
| SCHEMBL7301110 | 0.76 | CYP3A4 (0.59) | CYP3A4CYP2D6CYP2C9SERPINE1CYP2A6 | |
| SCHEMBL3154669 | 0.76 | CYP2D6 (0.58) | CYP3A4CYP2D6CYP2C9SERPINE1CYP1A2 | |
| SCHEMBL11542731 | 0.74 | TDP1 (0.66) | CYP3A4CYP2D6CYP2C9TSHRSERPINE1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1335901-B1 | PHARMACEUTICALLY ACTIVE SULFANILIDE DERIVATIVES | MERCK SERONO SA (CH) | 2010-04-14 | — | — | EP | disclosed |